dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)

C34H40Cl2N2P2Pd — CID 88813042

IUPACdichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
SMILESCl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2
InChIKeyKEWSGOQKIRNBOJ-UHFFFAOYSA-L
MW715.98 g/mol
LogP8.42
Rot. Bonds6

About dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)

dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) (PubChem CID 88813042) has the molecular formula C34H40Cl2N2P2Pd and a molecular weight of 715.98 g/mol. Its IUPAC name is dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane).

Molecular Properties

Compound Namedichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
PubChem CID88813042
Molecular FormulaC34H40Cl2N2P2Pd
Molecular Weight715.98 g/mol
Exact Mass714.11
IUPAC Namedichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)
SMILESCl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1
InChIInChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2
InChIKeyKEWSGOQKIRNBOJ-UHFFFAOYSA-L
XLogP8.42
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.98
LogP ≤ 58.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

diphenyl(pyrrolidin-1-yl)phosphane;phenyl(dipyrrolidin-1-yl)phosphane
CID 88816907
dichloropalladium;ethene;bis(triphenylphosphane)
CID 44891218
[2-(1-diphenylphosphanylpyrrolidin-2-yl)pyrrolidin-1-yl]-diphenylphosphane
CID 85046658
1-adamantyl-phenyl-piperidin-1-ylphosphane
CID 174986647
4,5-dihydroimidazol-1-yl(diphenyl)phosphane
CID 91105862
(4-hexylpiperidin-1-yl)-diphenylphosphane
CID 59090045
dichloropalladium;diphenylphosphane;iron
CID 175532989
dichloropalladium;diiodocopper;bis(triphenylphosphane)
CID 173103937
dichloropalladium;bis(ethyl(diphenyl)phosphane)
CID 22638849
1-benzylazepane
CID 10954328
ditert-butyl(phenyl)phosphane;dichloropalladium
CID 87286096
N-butyl-N-[phenyl(pyrrolidin-1-yl)phosphanyl]butan-1-amine
CID 134885744

Frequently Asked Questions

What is the IUPAC name of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The IUPAC name of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) (CID 88813042) is dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane).
What is the SMILES notation for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The canonical SMILES for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) is Cl[Pd]Cl.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.c1ccc(P(c2ccccc2)N2CCCCC2)cc1.
What is the InChIKey of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
The InChIKey is KEWSGOQKIRNBOJ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C17H20NP.2ClH.Pd/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*1-2,4-7,10-13H,3,8-9,14-15H2;2*1H;/q;;;;+2/p-2.
What are the key properties of dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane)?
dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) has a molecular weight of 715.98 g/mol, XLogP of 8.42, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloropalladium;bis(diphenyl(piperidin-1-yl)phosphane) is sourced from PubChem (CID 88813042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).